ethenyl(diethyl)phosphane

C6H13P — CID 15217592

IUPACethenyl(diethyl)phosphane
SMILESC=CP(CC)CC
InChIInChI=1S/C6H13P/c1-4-7(5-2)6-3/h4H,1,5-6H2,2-3H3
InChIKeyVCKGZOHSRDVCPM-UHFFFAOYSA-N
MW116.14 g/mol
LogP2.65
Rot. Bonds3

About ethenyl(diethyl)phosphane

ethenyl(diethyl)phosphane (PubChem CID 15217592) has the molecular formula C6H13P and a molecular weight of 116.14 g/mol. Its IUPAC name is ethenyl(diethyl)phosphane.

Molecular Properties

Compound Nameethenyl(diethyl)phosphane
PubChem CID15217592
Molecular FormulaC6H13P
Molecular Weight116.14 g/mol
Exact Mass116.08
IUPAC Nameethenyl(diethyl)phosphane
SMILESC=CP(CC)CC
InChIInChI=1S/C6H13P/c1-4-7(5-2)6-3/h4H,1,5-6H2,2-3H3
InChIKeyVCKGZOHSRDVCPM-UHFFFAOYSA-N
XLogP2.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.14
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethenyl(diethyl)phosphane?
The IUPAC name of ethenyl(diethyl)phosphane (CID 15217592) is ethenyl(diethyl)phosphane.
What is the SMILES notation for ethenyl(diethyl)phosphane?
The canonical SMILES for ethenyl(diethyl)phosphane is C=CP(CC)CC.
What is the InChIKey of ethenyl(diethyl)phosphane?
The InChIKey is VCKGZOHSRDVCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13P/c1-4-7(5-2)6-3/h4H,1,5-6H2,2-3H3.
What are the key properties of ethenyl(diethyl)phosphane?
ethenyl(diethyl)phosphane has a molecular weight of 116.14 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl(diethyl)phosphane is sourced from PubChem (CID 15217592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).